Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iiq_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASP 210.A O no hydrogen 2.626 N/A ARG 3.A N HIS 31.A O no hydrogen 2.861 N/A LYS 6.A N TYR 28.A O no hydrogen 2.856 N/A GLN 8.A N TYR 26.A O no hydrogen 3.089 N/A GLN 8.A NE2 TYR 28.A OH no hydrogen 3.327 N/A GLN 8.A NE2 GLY 317.A O no hydrogen 2.710 N/A TYR 10.A N ASN 24.A O no hydrogen 2.955 N/A TYR 10.A OH PRO 321.A O no hydrogen 2.353 N/A SER 11.A OG HIS 13.A O no hydrogen 3.290 N/A ARG 12.A N TYR 22.A O no hydrogen 2.837 N/A ARG 12.A NE SER 322.A O no hydrogen 3.457 N/A ASN 21.A N THR 70.A O no hydrogen 2.858 N/A ASN 24.A N TYR 10.A O no hydrogen 2.665 N/A ASN 24.A ND2 SER 322.A O no hydrogen 2.872 N/A CYS 25.A N SER 65.A O no hydrogen 2.742 N/A TYR 26.A N GLN 8.A O no hydrogen 2.914 N/A VAL 27.A N LEU 63.A O no hydrogen 3.086 N/A TYR 28.A N LYS 6.A O no hydrogen 3.030 N/A PHE 30.A N PHE 61.A O no hydrogen 3.449 N/A HIS 31.A N ARG 3.A O no hydrogen 3.114 N/A ILE 37.A N GLU 36.A OE2 no hydrogen 3.084 N/A ASP 38.A N ARG 80.A O no hydrogen 2.900 N/A LEU 40.A N SER 78.A O no hydrogen 2.946 N/A LYS 41.A N GLU 44.A O no hydrogen 2.810 N/A ASN 42.A N GLN 76.A O no hydrogen 2.581 N/A GLU 44.A N LYS 41.A O no hydrogen 2.970 N/A ILE 46.A N LEU 39.A O no hydrogen 3.084 N/A GLU 49.A N HIS 66.A O no hydrogen 2.703 N/A SER 51.A N LEU 64.A O no hydrogen 3.123 N/A SER 51.A OG ASP 52.A O no hydrogen 3.483 N/A SER 51.A OG LEU 64.A O no hydrogen 3.457 N/A SER 54.A N TYR 62.A O no hydrogen 3.429 N/A SER 54.A OG TYR 62.A OH no hydrogen 2.815 N/A SER 54.A OG TYR 123.A OH no hydrogen 2.515 N/A SER 56.A N SER 60.A O no hydrogen 2.889 N/A TRP 59.A N SER 56.A O no hydrogen 3.131 N/A TRP 59.A NE1 ASP 213.A OD1 no hydrogen 2.686 N/A SER 60.A N ASP 58.A OD1 no hydrogen 3.430 N/A SER 60.A OG ASP 58.A OD1 no hydrogen 2.873 N/A PHE 61.A N PHE 30.A O no hydrogen 2.938 N/A TYR 62.A N SER 54.A O no hydrogen 2.995 N/A LEU 63.A N VAL 27.A O no hydrogen 2.776 N/A LEU 64.A N SER 51.A OG no hydrogen 2.945 N/A SER 65.A N CYS 25.A O no hydrogen 3.174 N/A SER 65.A OG GLU 49.A O no hydrogen 3.403 N/A HIS 66.A N GLU 49.A O no hydrogen 2.761 N/A ALA 67.A N LEU 23.A O no hydrogen 3.152 N/A THR 70.A N ASN 21.A O no hydrogen 2.529 N/A THR 70.A OG1 ASN 21.A O no hydrogen 3.178 N/A GLN 76.A N ASN 42.A OD1 no hydrogen 2.932 N/A SER 78.A N LEU 40.A O no hydrogen 3.017 N/A CYS 79.A SG ASP 38.A O no hydrogen 3.634 N/A ARG 80.A N ASP 38.A O no hydrogen 2.730 N/A ARG 80.A NH1 ASP 38.A OD2 no hydrogen 2.526 N/A VAL 81.A N ARG 90.A O no hydrogen 3.033 N/A LYS 82.A N GLU 36.A O no hydrogen 3.486 N/A HIS 83.A ND1 THR 85.A OG1 no hydrogen 2.895 N/A HIS 83.A NE2 PRO 32.A O no hydrogen 2.900 N/A THR 85.A N HIS 83.A ND1 no hydrogen 3.263 N/A THR 85.A OG1 HIS 83.A ND1 no hydrogen 2.895 N/A LEU 86.A N HIS 83.A O no hydrogen 2.960 N/A ARG 90.A N VAL 81.A O no hydrogen 3.028 N/A VAL 92.A N CYS 79.A O no hydrogen 3.117 N/A TRP 94.A N TYR 77.A O no hydrogen 2.525 N/A ARG 97.A NH1 GLN 272.A O no hydrogen 3.189 N/A ARG 97.A NH2 ARG 273.A O no hydrogen 2.391 N/A HIS 99.A N LEU 195.A O no hydrogen 2.978 N/A HIS 99.A ND1 ASP 125.A OD2 no hydrogen 2.675 N/A SER 100.A N ASP 125.A OD1 no hydrogen 3.012 N/A LEU 101.A N CYS 193.A O no hydrogen 2.777 N/A ARG 102.A N TYR 123.A O no hydrogen 2.646 N/A TYR 103.A N ILE 191.A O no hydrogen 2.807 N/A PHE 104.A N ALA 121.A O no hydrogen 2.876 N/A ARG 105.A N ARG 189.A O no hydrogen 2.787 N/A LEU 106.A N ILE 119.A O no hydrogen 2.779 N/A GLY 107.A N TYR 187.A O no hydrogen 2.551 N/A ILE 108.A N GLU 117.A O no hydrogen 2.794 N/A SER 109.A N HIS 185.A O no hydrogen 2.987 N/A SER 109.A OG GLY 183.A O no hydrogen 2.507 N/A SER 109.A OG HIS 185.A O no hydrogen 3.207 N/A PHE 118.A N SER 134.A OG no hydrogen 3.139 N/A ILE 119.A N LEU 106.A O no hydrogen 2.956 N/A SER 120.A N TYR 132.A O no hydrogen 2.881 N/A SER 120.A OG PHE 104.A O no hydrogen 3.335 N/A ALA 121.A N PHE 104.A O no hydrogen 3.265 N/A GLY 122.A N THR 130.A O no hydrogen 3.330 N/A TYR 123.A N ARG 102.A O no hydrogen 2.678 N/A VAL 124.A N HIS 127.A O no hydrogen 3.075 N/A ASP 125.A N SER 100.A O no hydrogen 3.026 N/A HIS 127.A N VAL 124.A O no hydrogen 2.890 N/A HIS 127.A NE2 TYR 295.A OH no hydrogen 2.826 N/A ILE 129.A N GLY 122.A O no hydrogen 3.064 N/A MET 131.A N GLU 139.A O no hydrogen 2.802 N/A TYR 132.A OH GLN 165.A OE1 no hydrogen 2.636 N/A SER 134.A N PHE 118.A O no hydrogen 3.030 N/A SER 134.A OG PHE 118.A O no hydrogen 3.550 N/A SER 136.A N ASN 133.A OD1 no hydrogen 2.914 N/A SER 136.A OG ASN 133.A OD1 no hydrogen 3.181 N/A SER 136.A OG SER 136.A O no hydrogen 2.399 N/A GLN 137.A NE2 GLN 165.A OE1 no hydrogen 3.468 N/A LEU 138.A N SER 136.A O no hydrogen 2.599 N/A ARG 141.A N ILE 129.A O no hydrogen 2.457 N/A ARG 141.A NE PRO 140.A O no hydrogen 3.301 N/A ARG 141.A NH2 GLU 139.A OE1 no hydrogen 3.059 N/A MET 145.A N ALA 142.A O no hydrogen 3.219 N/A GLU 147.A N LEU 143.A O no hydrogen 3.199 N/A ASN 148.A ND2 TRP 144.A O no hydrogen 3.467 N/A HIS 153.A N ALA 150.A O no hydrogen 2.984 N/A GLU 155.A N PRO 151.A O no hydrogen 3.324 N/A ARG 156.A N ASP 152.A O no hydrogen 3.078 N/A ARG 156.A N HIS 153.A O no hydrogen 3.257 N/A TYR 157.A N HIS 153.A O no hydrogen 3.148 N/A THR 158.A N TRP 154.A O no hydrogen 2.925 N/A LEU 160.A N ARG 156.A O no hydrogen 3.408 N/A LEU 161.A N TYR 157.A O no hydrogen 2.835 N/A ARG 162.A N THR 158.A O no hydrogen 3.376 N/A ARG 162.A NE GLN 137.A O no hydrogen 3.422 N/A ARG 162.A NH2 GLN 137.A O no hydrogen 3.182 N/A GLY 163.A N GLN 159.A O no hydrogen 3.265 N/A TRP 164.A N LEU 160.A O no hydrogen 2.798 N/A GLN 165.A N LEU 161.A O no hydrogen 2.638 N/A GLN 166.A N ARG 162.A O no hydrogen 3.332 N/A ALA 167.A N GLY 163.A O no hydrogen 3.023 N/A PHE 168.A N TRP 164.A O no hydrogen 2.971 N/A LYS 169.A N GLN 165.A O no hydrogen 3.081 N/A VAL 170.A N GLN 166.A O no hydrogen 3.137 N/A GLU 171.A N ALA 167.A O no hydrogen 3.098 N/A LEU 172.A N PHE 168.A O no hydrogen 3.108 N/A LYS 173.A N LYS 169.A O no hydrogen 3.259 N/A LYS 173.A NZ GLU 110.A OE1 no hydrogen 2.889 N/A GLN 174.A N VAL 170.A O no hydrogen 2.981 N/A LEU 175.A N GLU 171.A O no hydrogen 3.055 N/A GLN 176.A N LEU 172.A O no hydrogen 3.069 N/A GLN 176.A NE2 GLY 183.A O no hydrogen 3.419 N/A GLN 176.A NE2 HIS 185.A ND1 no hydrogen 3.556 N/A HIS 177.A N LYS 173.A O no hydrogen 3.046 N/A HIS 178.A N GLN 174.A O no hydrogen 3.201 N/A TYR 179.A N LEU 175.A O no hydrogen 2.811 N/A TYR 179.A OH ASP 228.A OD2 no hydrogen 2.285 N/A ASN 180.A N HIS 177.A O no hydrogen 3.222 N/A HIS 181.A N GLN 176.A O no hydrogen 3.085 N/A HIS 181.A NE2 TYR 209.A OH no hydrogen 2.994 N/A HIS 185.A N SER 109.A OG no hydrogen 2.862 N/A THR 186.A N ASP 210.A OD1 no hydrogen 2.951 N/A THR 186.A OG1 HIS 31.A NE2 no hydrogen 3.252 N/A TYR 187.A N GLY 107.A O no hydrogen 2.684 N/A TYR 187.A OH GLU 171.A OE1 no hydrogen 2.991 N/A GLN 188.A N ALA 208.A O no hydrogen 2.792 N/A GLN 188.A NE2 TRP 59.A O no hydrogen 2.874 N/A ARG 189.A N ARG 105.A O no hydrogen 2.920 N/A MET 190.A N GLN 206.A O no hydrogen 2.920 N/A ILE 191.A N TYR 103.A O no hydrogen 2.961 N/A GLY 192.A N PHE 204.A O no hydrogen 3.085 N/A CYS 193.A N LEU 101.A O no hydrogen 2.956 N/A GLU 194.A N THR 202.A O no hydrogen 3.036 N/A LEU 195.A N HIS 99.A O no hydrogen 2.600 N/A LEU 196.A N SER 200.A O no hydrogen 2.800 N/A GLY 199.A N LEU 196.A O no hydrogen 3.322 N/A SER 200.A N ASP 198.A OD1 no hydrogen 3.211 N/A THR 202.A N GLU 194.A O no hydrogen 3.220 N/A THR 202.A OG1 GLU 194.A OE1 no hydrogen 3.465 N/A PHE 204.A N GLY 192.A O no hydrogen 2.867 N/A GLN 206.A N MET 190.A O no hydrogen 2.900 N/A TYR 207.A N LEU 215.A O no hydrogen 2.744 N/A ALA 208.A N GLN 188.A O no hydrogen 2.722 N/A TYR 209.A N GLN 212.A O no hydrogen 3.095 N/A TYR 209.A OH HIS 181.A NE2 no hydrogen 2.994 N/A ASP 210.A N THR 186.A O no hydrogen 2.872 N/A GLN 212.A N TYR 209.A O no hydrogen 3.274 N/A PHE 214.A N TYR 207.A O no hydrogen 2.876 N/A LEU 215.A N TYR 207.A O no hydrogen 3.245 N/A ILE 216.A N MET 225.A O no hydrogen 2.989 N/A PHE 217.A N LEU 205.A O no hydrogen 2.960 N/A ASN 218.A N SER 223.A O no hydrogen 2.840 N/A THR 221.A N ASN 218.A OD1 no hydrogen 2.787 N/A THR 221.A OG1 ASN 218.A OD1 no hydrogen 2.910 N/A THR 221.A OG1 SER 223.A OG no hydrogen 2.679 N/A SER 223.A N ASN 218.A O no hydrogen 3.269 N/A SER 223.A OG THR 221.A OG1 no hydrogen 2.679 N/A TRP 224.A N GLU 239.A OE2 no hydrogen 2.884 N/A MET 225.A N ILE 216.A O no hydrogen 2.684 N/A ILE 233.A N VAL 230.A O no hydrogen 3.099 N/A ARG 235.A N ALA 231.A O no hydrogen 3.082 N/A ARG 236.A N ASP 232.A O no hydrogen 3.222 N/A VAL 237.A N ILE 233.A O no hydrogen 3.394 N/A TRP 238.A N ILE 234.A O no hydrogen 2.809 N/A GLU 239.A N ARG 235.A O no hydrogen 2.918 N/A ALA 240.A N ARG 236.A O no hydrogen 3.285 N/A ASN 241.A N TRP 238.A O no hydrogen 3.169 N/A GLU 244.A N ASN 241.A O no hydrogen 3.047 N/A LEU 245.A N ASN 241.A O no hydrogen 3.382 N/A GLN 246.A N ARG 242.A O no hydrogen 3.068 N/A TYR 247.A N HIS 243.A O no hydrogen 3.036 N/A GLN 248.A N GLU 244.A O no hydrogen 3.051 N/A LYS 249.A N LEU 245.A O no hydrogen 3.232 N/A ASN 250.A N GLN 246.A O no hydrogen 3.104 N/A TRP 251.A N TYR 247.A O no hydrogen 3.061 N/A LEU 252.A N GLN 248.A O no hydrogen 3.001 N/A GLU 253.A N LYS 249.A O no hydrogen 2.931 N/A GLU 254.A N ASN 250.A O no hydrogen 2.873 N/A GLU 255.A N ASN 250.A O no hydrogen 3.257 N/A CYS 256.A N TRP 251.A O no hydrogen 2.528 N/A ALA 258.A N GLU 254.A O no hydrogen 3.096 N/A TRP 259.A N GLU 255.A O no hydrogen 3.135 N/A LEU 260.A N CYS 256.A O no hydrogen 2.852 N/A LYS 261.A N ILE 257.A O no hydrogen 2.981 N/A ARG 262.A N ALA 258.A O no hydrogen 3.107 N/A ARG 262.A NE TYR 266.A OH no hydrogen 3.150 N/A PHE 263.A N TRP 259.A O no hydrogen 2.941 N/A LEU 264.A N LEU 260.A O no hydrogen 2.905 N/A GLU 265.A N LYS 261.A O no hydrogen 3.233 N/A GLY 267.A N PHE 263.A O no hydrogen 3.028 N/A ALA 270.A N GLY 267.A O no hydrogen 3.249 N/A LEU 271.A N GLY 267.A O no hydrogen 2.968 N/A GLU 275.A N TYR 295.A O no hydrogen 2.969 N/A LYS 278.A N TYR 292.A O no hydrogen 3.051 N/A ARG 280.A N ARG 290.A O no hydrogen 2.950 N/A ARG 280.A NE VAL 279.A O no hydrogen 3.132 N/A ASN 282.A N TYR 288.A O no hydrogen 2.734 N/A LYS 284.A N THR 286.A O no hydrogen 3.131 N/A THR 285.A OG1 LYS 284.A O no hydrogen 3.189 N/A LEU 287.A N VAL 333.A O no hydrogen 2.870 N/A TYR 288.A N ASN 282.A O no hydrogen 2.549 N/A CYS 289.A N VAL 331.A O no hydrogen 2.986 N/A ARG 290.A N ARG 280.A O no hydrogen 2.672 N/A ALA 291.A N THR 329.A O no hydrogen 3.180 N/A TYR 292.A N LYS 278.A O no hydrogen 2.787 N/A PHE 294.A N TYR 327.A O no hydrogen 2.974 N/A TYR 295.A N GLU 275.A O no hydrogen 2.982 N/A TYR 295.A OH HIS 127.A NE2 no hydrogen 2.826 N/A SER 300.A N GLU 346.A O no hydrogen 3.170 N/A SER 300.A OG GLU 346.A O no hydrogen 3.542 N/A ASN 302.A N HIS 344.A O no hydrogen 3.020 N/A ASN 302.A ND2 HIS 344.A ND1 no hydrogen 3.345 N/A TRP 303.A NE1 VAL 331.A O no hydrogen 2.787 N/A MET 304.A N SER 342.A O no hydrogen 2.871 N/A LYS 305.A N GLU 308.A O no hydrogen 2.675 N/A ASN 306.A N ILE 340.A O no hydrogen 3.273 N/A GLU 308.A N LYS 305.A O no hydrogen 3.047 N/A ILE 310.A N TRP 303.A O no hydrogen 3.182 N/A THR 314.A OG1 PHE 311.A O no hydrogen 3.524 N/A ASP 315.A N SER 332.A O no hydrogen 3.173 N/A LEU 320.A N GLN 328.A O no hydrogen 2.943 N/A SER 322.A N THR 326.A O no hydrogen 3.012 N/A SER 322.A OG ASP 324.A OD1 no hydrogen 3.150 N/A THR 326.A OG1 ASP 324.A OD1 no hydrogen 3.256 N/A TYR 327.A N PHE 294.A O no hydrogen 2.944 N/A GLN 328.A N LEU 320.A O no hydrogen 2.924 N/A GLN 328.A NE2 SER 11.A O no hydrogen 3.107 N/A GLN 328.A NE2 ARG 12.A O no hydrogen 3.380 N/A THR 329.A N ALA 291.A O no hydrogen 3.275 N/A TRP 330.A NE1 GLN 8.A OE1 no hydrogen 2.642 N/A VAL 331.A N CYS 289.A O no hydrogen 2.987 N/A SER 332.A N ASP 315.A O no hydrogen 3.464 N/A VAL 333.A N LEU 287.A O no hydrogen 3.137 N/A GLU 334.A N ASP 313.A O no hydrogen 3.238 N/A LEU 335.A N THR 285.A O no hydrogen 2.580 N/A ILE 340.A N ASN 306.A OD1 no hydrogen 2.556 N/A TYR 341.A N PHE 357.A O no hydrogen 2.871 N/A SER 342.A N MET 304.A O no hydrogen 3.235 N/A CYS 343.A N LEU 354.A O no hydrogen 2.880 N/A CYS 343.A SG HIS 344.A O no hydrogen 4.031 N/A HIS 344.A N ASN 302.A O no hydrogen 2.893 N/A HIS 344.A NE2 HIS 351.A ND1 no hydrogen 2.971 N/A VAL 345.A N MET 352.A O no hydrogen 2.752 N/A GLU 346.A N SER 300.A O no hydrogen 2.944 N/A HIS 347.A NE2 TYR 295.A O no hydrogen 2.914 N/A HIS 351.A ND1 HIS 344.A NE2 no hydrogen 2.971 N/A MET 352.A N VAL 345.A O no hydrogen 2.694 N/A LEU 354.A N CYS 343.A O no hydrogen 2.938 N/A GLY 356.A N TYR 341.A O no hydrogen 2.905 N/A PHE 357.A N TYR 341.A O no hydrogen 3.012 N/A